Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 5/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.45 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.45 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.45 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.44 |
| ▸ | SCN4A | P35499 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.43 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14069326 | 0.83 | TSHR (0.50) | KMT2AKEAP1NPC1IKBKETBK1 | |
| SCHEMBL29796107 | 0.81 | KMT2A (0.53) | KMT2ANPC1KDM4ESMN1; SMN2RAB9A | |
| SCHEMBL31323274 | 0.80 | TAAR1 (0.57) | KMT2AKEAP1NPC1KDM4ESMN1; SMN2 | |
| SCHEMBL31306170 | 0.80 | MAPT (0.47) | KMT2AKEAP1NPC1KDM4ESMN1; SMN2 | |
| SCHEMBL31306229 | 0.80 | KEAP1 (0.45) | KMT2AKEAP1NPC1KDM4ESMN1; SMN2 | |
| SCHEMBL31323277 | 0.80 | TAAR1 (0.57) | KMT2AKEAP1NPC1KDM4ESMN1; SMN2 | |
| SCHEMBL21286259 | 0.80 | KMT2A (0.60) | KMT2ANPC1KDM4ESMN1; SMN2RAB9A | |
| SCHEMBL14199838 | 0.79 | RAB9A (0.56) | KMT2ANPC1KDM4ESMN1; SMN2RAB9A | |
| SCHEMBL2629322 | 0.77 | KMT2A (0.60) | KMT2AKEAP1NPC1KDM4ESMN1; SMN2 | |
| SCHEMBL28937613 | 0.77 | KEAP1 (0.60) | KMT2AKEAP1NPC1IKBKETBK1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109153636-B | Cyclopropyl-amide compounds as dual LSD1/HDAC inhibitors | 朱比连特埃皮科尔有限责任公司 | 2021-10-22 | — | — | CN | disclosed |